methyl 2-(3-morpholin-4-ylpropylsulfamoyl)-6-nitro-benzoate

Systemtic Name: methyl 2-(3-morpholin-4-ylpropylsulfamoyl)-6-nitro-benzoate Openeye Name: methyl 2-(3-morpholinopropylsulfamoyl)-6-nitro-benzoate CAS Name: 2-[3-(4-morpholinyl)propylsulfamoyl]-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(3-morpholin-4-ylpropylsulfamoyl)-6-nitrobenzoate Traditional Name: 2-(3-morpholinopropylsulfamoyl)-6-nitro-benzoic acid methyl ester Formula: C15H21N3O7S MolecularWeight: 387.40814

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1S(=O)(=O)NCCCN2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CC=C1S(=O)(=O)NCCCN2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O7S/c1-24-15(19)14-12(18(20)21)4-2-5-13(14)26(22,23)16-6-3-7-17-8-10-25-11-9-17/h2,4-5,16H,3,6-11H2,1H3